| SpectraBase Compound ID | 93IMp3PFaUC |
|---|---|
| InChI | InChI=1S/C30H46O5/c1-18(9-8-10-19(2)24(33)34)20-11-13-29(7)25(35)30(16-15-27(20,29)5)23(32)17-21-26(3,4)22(31)12-14-28(21,30)6/h10,18,20-21,23,32H,8-9,11-17H2,1-7H3,(H,33,34)/b19-10-/t18-,20-,21-,23-,27-,28-,29+,30-/m0/s1 |
| InChIKey | NRHGLEFWYOMSMY-NBIZHPMCSA-N |
| Mol Weight | 486.7 g/mol |
| Molecular Formula | C30H46O5 |
| Exact Mass | 486.334525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GDGSjTG6Lw4 |
|---|---|
| Name | 3,8-DIOXO-7-BETA-HYDROXY-7,9-CYCLO-7,8-SECO-24Z-TIRUCALLADIEN-26-OIC-ACID |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O5 |
| InChI | InChI=1S/C30H46O5/c1-18(9-8-10-19(2)24(33)34)20-11-13-29(7)25(35)30(16-15-27(20,29)5)23(32)17-21-26(3,4)22(31)12-14-28(21,30)6/h10,18,20-21,23,32H,8-9,11-17H2,1-7H3,(H,33,34)/b19-10-/t18-,20-,21-,23-,27-,28-,29+,30-/m0/s1 |
| InChIKey | NRHGLEFWYOMSMY-NBIZHPMCSA-N |
| Literature Reference Author | M.MAKINO,T.MOTEGI,Y.FUJIMOTO |
| Literature Reference Citation | PHYTOCHEM.,65,891(2004) |
| Literature Reference DOI | 10.1016/j.phytochem.2003.12.012 |
| Molecular Weight | 486.692 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN31220 |